(2S)-N-(1,3-benzodioxol-5-ylmethyl)-2-(2-bromanylphenoxy)propanamide

Systemtic Name: (2S)-N-(1,3-benzodioxol-5-ylmethyl)-2-(2-bromanylphenoxy)propanamide Openeye Name: (2S)-N-(1,3-benzodioxol-5-ylmethyl)-2-(2-bromophenoxy)propanamide CAS Name: (2S)-N-(1,3-benzodioxol-5-ylmethyl)-2-(2-bromophenoxy)propanamide IUPAC Name: (2S)-N-(1,3-benzodioxol-5-ylmethyl)-2-(2-bromophenoxy)propanamide Traditional Name: (2S)-2-(2-bromophenoxy)-N-piperonyl-propionamide Formula: C17H16BrNO4 MolecularWeight: 378.21724

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC2=C(C=C1)OCO2)OC3=CC=CC=C3Br

Isomeric SMILES

C[C@@H](C(=O)NCC1=CC2=C(C=C1)OCO2)OC3=CC=CC=C3Br

InChI

InChI=1S/C17H16BrNO4/c1-11(23-14-5-3-2-4-13(14)18)17(20)19-9-12-6-7-15-16(8-12)22-10-21-15/h2-8,11H,9-10H2,1H3,(H,19,20)/t11-/m0/s1